Anharmonic Self-Energy of Phonons: Ab Initio Calculations and Neutron Spin Echo Measurements

We have calculated (ab initio) and measured (by spin-echo techniques) the anharmonic self-energy of phonons at the X-point of the Brillouin zone for isotopically pure germanium. The real part agrees with former, less accurate, high temperature data obtained by inelastic neutron scattering on natural germanium. For the imaginary part our results provide evidence that transverse acoustic phonons at the X-point are very long lived at low temperatures, i.e. their probability of decay approaches zero, as a consequence of an unusual decay mechanism allowed by energy conservation.Comment: 8 pages, 2 figures, pdf fil

The role of oxygen vacancies on the structure and the density of states of iron doped zirconia

In this paper we study, both with theoretical and experimental approach, the effect of iron doping in zirconia. Combining density functional theory (DFT) simulations with the experimental characterization of thin films, we show that iron is in the Fe3+ oxidation state and accordingly that the films are rich in oxygen vacancies (VO). VO favor the formation of the tetragonal phase in doped zirconia (ZrO2:Fe) and affect the density of state at the Fermi level as well as the local magnetization of Fe atoms. We also show that the Fe(2p) and Fe(3p) energy levels can be used as a marker for the presence of vacancies in the doped system. In particular the computed position of the Fe(3p) peak is strongly sensitive to the VO to Fe atoms ratio. A comparison of the theoretical and experimental Fe(3p) peak position suggests that in our films this ratio is close to 0.5. Besides the interest in the material by itself, ZrO2:Fe constitutes a test case for the application of DFT on transition metals embedded in oxides. In ZrO2:Fe the inclusion of the Hubbard U correction significantly changes the electronic properties of the system. However the inclusion of this correction, at least for the value U = 3.3 eV chosen in the present work, worsen the agreement with the measured photo-emission valence band spectra.Comment: 24 pages, 8 figure

A Renaissance study of Am stars. I. The mass ratio distribution

Triggered by the study of Carquillat & Prieur (2007, MNRAS, 380, 1064) of Am binaries, I reanalyse their sample of 60 orbits to derive the mass ratio distribution (MRD), assuming as they did a priori functional forms, i.e. a power law or a Gaussian. The sample is then extended using orbits published by several groups and a full analysis of the MRD is made, without any assumption on the functional form. I derive the MRD using a Richardson-Lucy inversion method, assuming a fixed mass of the Am primary and randomly distributed orbital inclinations. Using the large sub-sample of double-lined spectroscopic binaries, I show that this methodology is indeed perfectly adequate. Using the inversion method, applied to my extended sample of 162 systems, I find that the final MRD can be approximated by a uniform distribution.Comment: 7 pages, 9 figures; Accepted by A&

Contribution to the search for binaries among Am stars — V. Orbital elements of eight short-period spectroscopic binaries

We present the results of a radial-velocity study of eight Am stars (HD 341, 55822, 61250, 67317, 93991, 162950, 224890 and 225137) observed at Observatoire de Haute-Provence with the CORAVEL instrument. We find that these systems are single-line spectroscopic binaries whose orbital elements are determined for the first tim

Measurement of the temperature of an ultracold ion source using time-dependent electric fields

We report on a measurement of the characteristic temperature of an ultracold rubidium ion source, in which a cloud of laser-cooled atoms is converted to ions by photo-ionization. Extracted ion pulses are focused on a detector with a pulsed-field technique. The resulting experimental spot sizes are compared to particle-tracking simulations, from which a source temperature $T = (1 \pm 2)$ mK and the corresponding transversal reduced emittance $\epsilon_r = 7.9 X 10^{-9}$ m rad $\sqrt{\rm{eV}}$ are determined. We find that this result is likely limited by space charge forces even though the average number of ions per bunch is 0.022.Comment: 8 pages, 11 figure

A search for solar-like oscillations in the Am star HD 209625

The goal is to test the structure of hot metallic stars, and in particular the structure of a near-surface convection zone using asteroseismic measurements. Indeed, stellar models including a detailed treatement of the radiative diffusion predict the existence of a near-surface convection zone in order to correctly reproduce the anomalies in surface abundances that are observed in Am stars. The Am star HD 209625 was observed with the Harps spectrograph mounted on the 3.6-m telescope at the ESO La Silla Observatory (Chile) during 9 nights in August 2005. This observing run allowed us to collect 1243 radial velocity (RV) measurements, with a standard deviation of 1.35 m/s. The power spectrum associated with these RV measurements does not present any excess. Therefore, either the structure of the external layers of this star does not allow excitation of solar-like oscillations, or the amplitudes of the oscillations remain below 20-30 cm/s (depending on their frequency range).Comment: 5 pages, 4 figures, A&A accepte

Ultrafast dynamics of coherent optical phonons and nonequilibrium electrons in transition metals

The femtosecond optical pump-probe technique was used to study dynamics of photoexcited electrons and coherent optical phonons in transition metals Zn and Cd as a function of temperature and excitation level. The optical response in time domain is well fitted by linear combination of a damped harmonic oscillation because of excitation of coherent $E_{2g}$ phonon and a subpicosecond transient response due to electron-phonon thermalization. The electron-phonon thermalization time monotonically increases with temperature, consistent with the thermomodulation scenario, where at high temperatures the system can be well explained by the two-temperature model, while below $\approx$ 50 K the nonthermal electron model needs to be applied. As the lattice temperature increases, the damping of the coherent $E_{2g}$ phonon increases, while the amplitudes of both fast electronic response and the coherent $E_{2g}$ phonon decrease. The temperature dependence of the damping of the $E_{2g}$ phonon indicates that population decay of the coherent optical phonon due to anharmonic phonon-phonon coupling dominates the decay process. We present a model that accounts for the observed temperature dependence of the amplitude assuming the photoinduced absorption mechanism, where the signal amplitude is proportional to the photoinduced change in the quasiparticle density. The result that the amplitude of the $E_{2g}$ phonon follows the temperature dependence of the amplitude of the fast electronic transient indicates that under the resonant condition both electronic and phononic responses are proportional to the change in the dielectric function.Comment: 10 pages, 9 figures, to appear in Physical Review

Non-linear optical susceptibilities, Raman efficiencies and electrooptic tensors from first-principles density functional perturbation theory

The non-linear response of infinite periodic solids to homogenous electric fields and collective atomic displacements is discussed in the framework of density functional perturbation theory. The approach is based on the 2n + 1 theorem applied to an electric-field-dependent energy functional. We report the expressions for the calculation of the non-linear optical susceptibilities, Raman scattering efficiencies and electrooptic coefficients. Different formulations of third-order energy derivatives are examined and their convergence with respect to the k-point sampling is discussed. We apply our method to a few simple cases and compare our results to those obtained with distinct techniques. Finally, we discuss the effect of a scissors correction on the EO coefficients and non-linear optical susceptibilities

Anharmonic Decay of Vibrational States in Amorphous Silicon

Anharmonic decay rates are calculated for a realistic atomic model of amorphous silicon. The results show that the vibrational states decay on picosecond timescales and follow the two-mode density of states, similar to crystalline silicon, but somewhat faster. Surprisingly little change occurs for localized states. These results disagree with a recent experiment.Comment: 10 pages, 4 Postscript figure